5-methyl-7-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-2-phenylazanyl-1,8-naphthyridin-4-one

Systemtic Name: 5-methyl-7-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-2-phenylazanyl-1,8-naphthyridin-4-one Openeye Name: 2-anilino-5-methyl-7-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-1,8-naphthyridin-4-one CAS Name: 2-anilino-5-methyl-7-(4-methylsulfonyl-1-piperazinyl)-1-phenyl-1,8-naphthyridin-4-one IUPAC Name: 2-anilino-5-methyl-7-(4-methylsulfonylpiperazin-1-yl)-1-phenyl-1,8-naphthyridin-4-one Traditional Name: 2-anilino-7-(4-mesylpiperazino)-5-methyl-1-phenyl-1,8-naphthyridin-4-one Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=O)C=C(N2C3=CC=CC=C3)NC4=CC=CC=C4)N5CCN(CC5)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=O)C=C(N2C3=CC=CC=C3)NC4=CC=CC=C4)N5CCN(CC5)S(=O)(=O)C

InChI

InChI=1S/C26H27N5O3S/c1-19-17-23(29-13-15-30(16-14-29)35(2,33)34)28-26-25(19)22(32)18-24(27-20-9-5-3-6-10-20)31(26)21-11-7-4-8-12-21/h3-12,17-18,27H,13-16H2,1-2H3